N-(3-bicyclo[2.2.1]heptanyl)-7-chloranyl-5-methylsulfonyl-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide

Systemtic Name: N-(3-bicyclo[2.2.1]heptanyl)-7-chloranyl-5-methylsulfonyl-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide Openeye Name: 7-chloro-5-methylsulfonyl-N-norbornan-2-yl-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide CAS Name: N-(3-bicyclo[2.2.1]heptanyl)-7-chloro-5-methylsulfonyl-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide IUPAC Name: N-(3-bicyclo[2.2.1]heptanyl)-7-chloro-5-methylsulfonyl-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide Traditional Name: 7-chloro-5-mesyl-N-(2-norbornyl)-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide Formula: C18H23ClN2O4S MolecularWeight: 398.90422

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(OC2=C1C=C(C=C2)Cl)C(=O)NC3CC4CCC3C4

Isomeric SMILES

CS(=O)(=O)N1CCC(OC2=C1C=C(C=C2)Cl)C(=O)NC3CC4CCC3C4

InChI

InChI=1S/C18H23ClN2O4S/c1-26(23,24)21-7-6-17(25-16-5-4-13(19)10-15(16)21)18(22)20-14-9-11-2-3-12(14)8-11/h4-5,10-12,14,17H,2-3,6-9H2,1H3,(H,20,22)